16-phenylsulfanylhexadeca-5,8,11,14-tetraynoic acid

Systemtic Name: 16-phenylsulfanylhexadeca-5,8,11,14-tetraynoic acid Openeye Name: 16-phenylsulfanylhexadeca-5,8,11,14-tetraynoic acid CAS Name: 16-(phenylthio)hexadeca-5,8,11,14-tetraynoic acid IUPAC Name: 16-phenylsulfanylhexadeca-5,8,11,14-tetraynoic acid Traditional Name: 16-(phenylthio)hexadeca-5,8,11,14-tetraynoic acid Formula: C22H20O2S MolecularWeight: 348.458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC#CCC#CCC#CCC#CCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCC#CCC#CCC#CCC#CCCCC(=O)O

InChI

InChI=1S/C22H20O2S/c23-22(24)19-15-10-8-6-4-2-1-3-5-7-9-11-16-20-25-21-17-13-12-14-18-21/h12-14,17-18H,3-4,9-10,15,19-20H2,(H,23,24)